| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 19 | Yes |
Popular Name: 6-chloro-2-phenyl-3-quinolinyl methyl sulfide 6-chloro-2-phenyl-3-quinolinyl m…
Find On: PubMed — Wikipedia — Google
CAS Number: 400079-68-7
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.85 | 0.4 | -6.34 | 0 | 1 | 0 | 12 | 285.799 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.85 | 0.51 | -25.82 | 1 | 1 | 1 | 14 | 286.807 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 147 - 149 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
